Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4n95_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 58.A OE2 no hydrogen 3.160 N/A LYS 2.A N GLU 58.A O no hydrogen 3.091 N/A PHE 3.A N VAL 84.A O no hydrogen 3.097 N/A VAL 5.A N ILE 82.A O no hydrogen 2.907 N/A ARG 7.A N ALA 80.A O no hydrogen 2.864 N/A ARG 7.A NE CYS 73.A O no hydrogen 2.784 N/A ARG 7.A NH2 ARG 74.A O no hydrogen 2.789 N/A HIS 9.A N GLU 6.A O no hydrogen 2.998 N/A LEU 10.A N ARG 7.A O no hydrogen 2.961 N/A LEU 11.A N ARG 7.A O no hydrogen 3.245 N/A LEU 14.A N LEU 10.A O no hydrogen 2.891 N/A GLN 15.A N LEU 11.A O no hydrogen 3.075 N/A GLN 16.A N LYS 12.A O no hydrogen 2.931 N/A GLN 16.A NE2 ARG 199.A O no hydrogen 3.058 N/A VAL 17.A N PRO 13.A O no hydrogen 2.958 N/A SER 18.A N LEU 14.A O no hydrogen 3.034 N/A SER 18.A OG LEU 14.A O no hydrogen 2.736 N/A LEU 21.A N SER 18.A O no hydrogen 2.975 N/A GLY 25.A N PRO 22.A O no hydrogen 3.063 N/A ASN 26.A N ILE 23.A O no hydrogen 2.958 N/A LEU 27.A N VAL 64.A O no hydrogen 2.762 N/A LEU 28.A N THR 39.A O no hydrogen 2.866 N/A LEU 29.A N THR 62.A O no hydrogen 2.869 N/A GLN 30.A N SER 37.A O no hydrogen 3.030 N/A VAL 31.A N GLY 60.A O no hydrogen 2.769 N/A ALA 32.A N THR 35.A O no hydrogen 2.993 N/A THR 35.A N ALA 32.A O no hydrogen 2.875 N/A THR 35.A OG1 ASP 33.A O no hydrogen 3.317 N/A LEU 36.A N VAL 51.A O no hydrogen 2.759 N/A SER 37.A N GLN 30.A O no hydrogen 2.879 N/A LEU 38.A N ALA 49.A O no hydrogen 2.776 N/A THR 39.A N LEU 28.A O no hydrogen 2.860 N/A GLY 40.A N MET 47.A O no hydrogen 3.046 N/A THR 41.A OG1 MET 45.A O no hydrogen 2.675 N/A ASP 42.A N MET 45.A O no hydrogen 3.177 N/A LEU 43.A N THR 41.A OG1 no hydrogen 3.022 N/A GLU 44.A N ASP 42.A OD1 no hydrogen 2.761 N/A MET 45.A N ASP 42.A OD1 no hydrogen 2.829 N/A GLU 46.A N THR 227.A O no hydrogen 2.731 N/A MET 47.A N GLY 40.A O no hydrogen 2.921 N/A VAL 48.A N ILE 225.A O no hydrogen 2.844 N/A ALA 49.A N LEU 38.A O no hydrogen 2.845 N/A ARG 50.A N ASP 223.A O no hydrogen 3.149 N/A ARG 50.A NH1 SER 37.A OG no hydrogen 2.755 N/A VAL 51.A N LEU 36.A O no hydrogen 2.738 N/A LEU 53.A N GLY 34.A O no hydrogen 2.956 N/A GLN 55.A NE2 GLU 81.A OE1 no hydrogen 3.370 N/A HIS 57.A ND1 GLN 55.A O no hydrogen 2.878 N/A GLU 58.A N LYS 2.A O no hydrogen 2.771 N/A GLY 60.A N VAL 31.A O no hydrogen 3.124 N/A THR 62.A N LEU 29.A O no hydrogen 2.998 N/A THR 63.A N LEU 105.A O no hydrogen 3.030 N/A THR 63.A OG1 ASN 26.A OD1 no hydrogen 3.087 N/A THR 63.A OG1 LEU 105.A O no hydrogen 2.695 N/A VAL 64.A N LEU 27.A O no hydrogen 3.042 N/A ALA 66.A N GLY 25.A O no hydrogen 2.966 N/A PHE 69.A N PRO 65.A O no hydrogen 3.094 N/A PHE 70.A N ALA 66.A O no hydrogen 2.838 N/A ASP 71.A N ARG 67.A O no hydrogen 2.803 N/A ILE 72.A N LYS 68.A O no hydrogen 2.991 N/A CYS 73.A N PHE 69.A O no hydrogen 3.062 N/A CYS 73.A SG PHE 69.A O no hydrogen 3.452 N/A ARG 74.A N PHE 70.A O no hydrogen 2.905 N/A ARG 74.A NH1 ASP 71.A OD1 no hydrogen 2.887 N/A ARG 74.A NH2 ASP 71.A OD1 no hydrogen 2.712 N/A GLY 75.A N ASP 71.A O no hydrogen 2.919 N/A LEU 76.A N ILE 72.A O no hydrogen 3.185 N/A LEU 76.A N CYS 73.A O no hydrogen 3.325 N/A ALA 80.A N PRO 77.A O no hydrogen 3.019 N/A ILE 82.A N VAL 5.A O no hydrogen 2.724 N/A ALA 83.A N ARG 94.A O no hydrogen 2.875 N/A VAL 84.A N PHE 3.A O no hydrogen 2.819 N/A GLN 85.A N LEU 92.A O no hydrogen 3.022 N/A GLN 85.A NE2 GLU 87.A OE1 no hydrogen 2.505 N/A GLN 85.A NE2 GLU 87.A OE2 no hydrogen 3.552 N/A LEU 86.A N MET 1.A O no hydrogen 3.011 N/A GLU 87.A N ARG 90.A O no hydrogen 2.787 N/A ARG 90.A N GLU 87.A O no hydrogen 3.297 N/A ARG 90.A NH1 GLU 89.A O no hydrogen 3.140 N/A MET 91.A N LEU 102.A O no hydrogen 2.830 N/A LEU 92.A N GLN 85.A O no hydrogen 2.773 N/A VAL 93.A N PHE 100.A O no hydrogen 2.851 N/A ARG 94.A N ALA 83.A O no hydrogen 2.835 N/A SER 95.A N SER 98.A O no hydrogen 2.976 N/A SER 95.A OG GLU 81.A O no hydrogen 2.746 N/A SER 98.A N SER 95.A O no hydrogen 2.922 N/A SER 98.A OG SER 95.A O no hydrogen 3.412 N/A PHE 100.A N VAL 93.A O no hydrogen 2.819 N/A LEU 102.A N MET 91.A O no hydrogen 2.888 N/A THR 104.A N GLU 89.A O no hydrogen 2.997 N/A THR 104.A OG1 GLY 88.A O no hydrogen 3.209 N/A LEU 105.A N THR 63.A O no hydrogen 3.183 N/A ASP 109.A N PRO 106.A O no hydrogen 3.027 N/A PHE 110.A N ALA 107.A O no hydrogen 2.943 N/A SER 118.A OG GLU 121.A OE2 no hydrogen 2.682 N/A GLU 119.A N ILE 212.A O no hydrogen 2.785 N/A VAL 120.A N ILE 212.A O no hydrogen 2.968 N/A PHE 122.A N VAL 210.A O no hydrogen 3.063 N/A LEU 124.A N LEU 208.A O no hydrogen 2.932 N/A GLN 126.A N ASN 206.A O no hydrogen 2.852 N/A THR 128.A N PRO 125.A O no hydrogen 2.956 N/A MET 129.A N PRO 125.A O no hydrogen 3.402 N/A LYS 130.A N GLN 126.A O no hydrogen 2.906 N/A LYS 130.A NZ LEU 201.A O no hydrogen 2.778 N/A ARG 131.A N ALA 127.A O no hydrogen 2.959 N/A ARG 131.A NH2 SER 350.A OG no hydrogen 2.856 N/A LEU 132.A N THR 128.A O no hydrogen 3.036 N/A ILE 133.A N MET 129.A O no hydrogen 3.059 N/A GLU 134.A N LYS 130.A O no hydrogen 2.874 N/A ALA 135.A N ARG 131.A O no hydrogen 2.941 N/A THR 136.A N ILE 133.A O no hydrogen 3.141 N/A THR 136.A OG1 LEU 132.A O no hydrogen 2.998 N/A THR 136.A OG1 ILE 133.A O no hydrogen 3.528 N/A THR 136.A OG1 THR 163.A OG1 no hydrogen 3.212 N/A GLN 137.A N ILE 133.A O no hydrogen 2.819 N/A SER 139.A N THR 136.A O no hydrogen 3.079 N/A MET 140.A N GLN 137.A O no hydrogen 3.083 N/A ALA 141.A N LEU 149.A O no hydrogen 3.070 N/A ASP 144.A N ASN 150.A OD1 no hydrogen 2.903 N/A ARG 146.A N ASP 144.A OD1 no hydrogen 2.695 N/A ARG 146.A NH1 ASP 144.A OD2 no hydrogen 3.152 N/A TYR 147.A OH ASP 232.A O no hydrogen 2.639 N/A LEU 149.A N ARG 146.A O no hydrogen 2.943 N/A ASN 150.A N TYR 147.A O no hydrogen 3.220 N/A ASN 150.A ND2 ASP 144.A O no hydrogen 3.007 N/A MET 152.A N VAL 189.A O no hydrogen 2.779 N/A LEU 153.A N VAL 164.A O no hydrogen 2.879 N/A PHE 154.A N VAL 187.A O no hydrogen 2.814 N/A GLU 155.A N ARG 162.A O.A no hydrogen 2.730 N/A GLU 155.A N ARG 162.A O.B no hydrogen 2.732 N/A THR 156.A N HIS 185.A O no hydrogen 2.755 N/A THR 156.A OG1 PRO 183.A O no hydrogen 2.673 N/A THR 156.A OG1 HIS 185.A O no hydrogen 3.389 N/A GLU 157.A N GLU 160.A O no hydrogen 3.095 N/A GLU 160.A N GLU 157.A O no hydrogen 2.955 N/A LEU 161.A N MET 176.A O no hydrogen 2.989 N/A ARG 162.A N.A GLU 155.A O no hydrogen 2.704 N/A ARG 162.A N.B GLU 155.A O no hydrogen 2.701 N/A ARG 162.A NE.A GLU 155.A OE1 no hydrogen 3.156 N/A ARG 162.A NE.B SER 175.A OG no hydrogen 2.992 N/A ARG 162.A NH1.A SER 175.A OG no hydrogen 3.299 N/A ARG 162.A NH1.B GLU 155.A OE1 no hydrogen 3.005 N/A ARG 162.A NH1.B GLU 157.A OE1 no hydrogen 2.980 N/A ARG 162.A NH2.A GLU 157.A OE1 no hydrogen 2.372 N/A ARG 162.A NH2.B GLU 157.A OE1 no hydrogen 3.260 N/A THR 163.A N CYS 174.A O no hydrogen 2.898 N/A THR 163.A OG1 LEU 132.A O no hydrogen 2.899 N/A THR 163.A OG1 THR 136.A OG1 no hydrogen 3.212 N/A VAL 164.A N LEU 153.A O no hydrogen 3.013 N/A ALA 165.A N ALA 172.A O no hydrogen 2.962 N/A THR 166.A OG1 ARG 170.A O no hydrogen 2.900 N/A ASP 167.A N ARG 170.A O no hydrogen 3.364 N/A GLY 168.A N THR 166.A OG1 no hydrogen 3.218 N/A HIS 169.A N ASP 167.A OD1 no hydrogen 2.884 N/A ARG 170.A N ASP 167.A OD1 no hydrogen 3.014 N/A ARG 170.A NE ASP 167.A OD2 no hydrogen 2.888 N/A ARG 170.A NH1 ASP 320.A OD2 no hydrogen 2.934 N/A LEU 171.A N VAL 354.A O no hydrogen 2.772 N/A ALA 172.A N ALA 165.A O no hydrogen 2.867 N/A VAL 173.A N ALA 352.A O no hydrogen 2.944 N/A CYS 174.A N THR 163.A O no hydrogen 3.045 N/A CYS 174.A SG SER 350.A O no hydrogen 3.597 N/A SER 175.A N SER 350.A O no hydrogen 2.980 N/A MET 176.A N LEU 161.A O no hydrogen 2.922 N/A ILE 178.A N GLU 159.A O no hydrogen 2.874 N/A GLN 180.A NE2 THR 123.A O no hydrogen 3.465 N/A LEU 182.A N GLY 158.A O no hydrogen 2.654 N/A HIS 185.A N THR 156.A O no hydrogen 3.075 N/A VAL 187.A N PHE 154.A O no hydrogen 3.036 N/A VAL 189.A N MET 152.A O no hydrogen 2.815 N/A ARG 191.A N ASN 150.A O no hydrogen 2.947 N/A ARG 191.A NH1 ALA 141.A O no hydrogen 2.850 N/A VAL 194.A N PRO 190.A O no hydrogen 2.915 N/A ILE 195.A N ARG 191.A O no hydrogen 2.980 N/A GLU 196.A N LYS 192.A O no hydrogen 3.027 N/A LEU 197.A N GLY 193.A O no hydrogen 2.867 N/A MET 198.A N VAL 194.A O no hydrogen 2.857 N/A ARG 199.A N ILE 195.A O no hydrogen 2.973 N/A MET 200.A N GLU 196.A O no hydrogen 2.997 N/A MET 200.A N LEU 197.A O no hydrogen 2.923 N/A LEU 201.A N MET 198.A O no hydrogen 3.216 N/A GLY 204.A N ASP 202.A OD1 no hydrogen 3.011 N/A ASN 206.A ND2 GLN 126.A OE1 no hydrogen 3.479 N/A LEU 208.A N LEU 124.A O no hydrogen 2.814 N/A ARG 209.A N HIS 220.A O no hydrogen 2.903 N/A ARG 209.A NH1 THR 123.A OG1 no hydrogen 3.077 N/A ARG 209.A NH2 GLU 121.A OE1 no hydrogen 3.197 N/A VAL 210.A N PHE 122.A O no hydrogen 2.846 N/A GLN 211.A N ARG 218.A O no hydrogen 2.886 N/A ILE 212.A N VAL 120.A O no hydrogen 2.794 N/A GLY 213.A N ASN 216.A O no hydrogen 2.820 N/A SER 214.A OG ASN 215.A OD1 no hydrogen 2.927 N/A ILE 217.A N SER 228.A O no hydrogen 2.886 N/A ARG 218.A N GLN 211.A O no hydrogen 2.838 N/A ARG 218.A NE THR 227.A OG1 no hydrogen 2.907 N/A ARG 218.A NH2 THR 227.A OG1 no hydrogen 3.246 N/A ALA 219.A N PHE 226.A O no hydrogen 2.891 N/A HIS 220.A N ARG 209.A O no hydrogen 2.804 N/A VAL 221.A N PHE 224.A O no hydrogen 3.014 N/A PHE 224.A N VAL 221.A O no hydrogen 2.871 N/A ILE 225.A N VAL 48.A O no hydrogen 2.877 N/A PHE 226.A N ALA 219.A O no hydrogen 2.922 N/A THR 227.A N GLU 46.A O no hydrogen 2.890 N/A SER 228.A N ILE 217.A O no hydrogen 2.916 N/A SER 228.A OG LYS 229.A O no hydrogen 2.770 N/A LYS 229.A N GLU 44.A O no hydrogen 2.767 N/A LYS 229.A NZ LEU 43.A O no hydrogen 3.422 N/A LEU 230.A N ASN 215.A O no hydrogen 2.888 N/A VAL 231.A N ILE 188.A O no hydrogen 2.779 N/A ARG 239.A N ASP 237.A OD1 no hydrogen 2.862 N/A ARG 239.A NE ASP 237.A OD2 no hydrogen 3.298 N/A ARG 240.A N ASP 237.A O no hydrogen 3.009 N/A VAL 241.A N TYR 238.A O no hydrogen 2.905 N/A LEU 242.A N TYR 238.A O no hydrogen 3.102 N/A LYS 248.A N LEU 334.A O no hydrogen 3.046 N/A LYS 248.A NZ ASP 247.A OD1 no hydrogen 2.977 N/A LYS 248.A NZ THR 335.A O no hydrogen 2.665 N/A HIS 249.A N SER 305.A O no hydrogen 3.016 N/A LEU 250.A N MET 332.A O no hydrogen 2.914 N/A GLU 251.A N THR 303.A O no hydrogen 2.733 N/A ALA 252.A N VAL 330.A O no hydrogen 3.140 N/A CYS 254.A N GLU 328.A O no hydrogen 2.891 N/A CYS 254.A SG LEU 322.A O no hydrogen 3.502 N/A LEU 257.A N GLY 253.A O no hydrogen 2.901 N/A LYS 258.A N CYS 254.A O no hydrogen 2.845 N/A GLN 259.A N ASP 255.A O no hydrogen 2.850 N/A GLN 259.A NE2 ASP 255.A OD1 no hydrogen 3.293 N/A GLN 259.A NE2 ASP 255.A OD2 no hydrogen 3.275 N/A ALA 260.A N LEU 256.A O no hydrogen 2.992 N/A PHE 261.A N LEU 257.A O no hydrogen 3.006 N/A ALA 262.A N LYS 258.A O no hydrogen 2.983 N/A ARG 263.A N GLN 259.A O no hydrogen 2.999 N/A ARG 263.A NE GLU 298.A OE2 no hydrogen 2.692 N/A ARG 263.A NH2 GLU 298.A OE1 no hydrogen 2.965 N/A ARG 263.A NH2 GLU 298.A OE2 no hydrogen 3.475 N/A ALA 264.A N ALA 260.A O no hydrogen 3.085 N/A ALA 265.A N PHE 261.A O no hydrogen 3.017 N/A ILE 266.A N ARG 263.A O no hydrogen 3.082 N/A LEU 267.A N ALA 264.A O no hydrogen 3.097 N/A SER 268.A N ALA 265.A O no hydrogen 2.999 N/A SER 268.A OG ALA 265.A O no hydrogen 2.728 N/A PHE 272.A N ASN 269.A O no hydrogen 3.039 N/A ARG 273.A NH1 ILE 266.A O no hydrogen 3.448 N/A VAL 275.A N PHE 313.A O no hydrogen 2.938 N/A ARG 276.A N THR 287.A O no hydrogen 2.881 N/A LEU 277.A N ILE 311.A O no hydrogen 2.697 N/A TYR 278.A N LYS 285.A O no hydrogen 2.722 N/A VAL 279.A N MET 309.A O no hydrogen 2.921 N/A SER 280.A N GLN 283.A O no hydrogen 3.183 N/A SER 280.A OG.B GLU 308.A OE2 no hydrogen 2.469 N/A GLN 283.A N SER 280.A O no hydrogen 3.108 N/A LEU 284.A N LEU 300.A O no hydrogen 2.920 N/A LYS 285.A N TYR 278.A O no hydrogen 2.944 N/A ILE 286.A N GLU 298.A O no hydrogen 2.867 N/A THR 287.A N ARG 276.A O no hydrogen 2.877 N/A ALA 288.A N ALA 296.A O no hydrogen 3.064 N/A ASN 290.A N GLU 294.A O no hydrogen 3.266 N/A GLN 293.A N ASN 290.A O no hydrogen 2.919 N/A ALA 296.A N ALA 288.A O no hydrogen 2.911 N/A GLU 298.A N ILE 286.A O no hydrogen 2.833 N/A LEU 300.A N LEU 284.A O no hydrogen 2.809 N/A VAL 302.A N ASN 282.A O no hydrogen 3.028 N/A THR 303.A N GLU 251.A O no hydrogen 2.987 N/A TYR 304.A OH ALA 307.A O no hydrogen 2.661 N/A SER 305.A N HIS 249.A O no hydrogen 2.985 N/A MET 309.A N VAL 279.A O no hydrogen 3.162 N/A ILE 311.A N LEU 277.A O no hydrogen 2.924 N/A PHE 313.A N VAL 275.A O no hydrogen 2.944 N/A VAL 315.A N ARG 273.A O no hydrogen 2.953 N/A SER 316.A OG ASN 314.A OD1 no hydrogen 2.743 N/A TYR 317.A N ASN 314.A OD1 no hydrogen 3.133 N/A VAL 318.A N ASN 314.A O no hydrogen 3.394 N/A LEU 319.A N VAL 315.A O no hydrogen 2.851 N/A ASP 320.A N SER 316.A O no hydrogen 2.905 N/A VAL 321.A N TYR 317.A O no hydrogen 3.374 N/A LEU 322.A N VAL 318.A O no hydrogen 2.959 N/A ASN 323.A N LEU 319.A O no hydrogen 2.799 N/A ALA 324.A N ASP 320.A O no hydrogen 3.021 N/A LEU 325.A N VAL 321.A O no hydrogen 2.961 N/A LYS 326.A N LEU 322.A O no hydrogen 3.391 N/A LYS 326.A NZ ASN 323.A O no hydrogen 3.125 N/A CYS 327.A SG ASN 329.A O no hydrogen 3.315 N/A VAL 330.A N ALA 252.A O no hydrogen 2.885 N/A ARG 331.A N GLU 344.A O no hydrogen 2.795 N/A MET 332.A N LEU 250.A O no hydrogen 2.766 N/A MET 333.A N GLN 342.A O no hydrogen 2.749 N/A LEU 334.A N LYS 248.A O no hydrogen 2.738 N/A VAL 338.A N ASP 336.A OD1 no hydrogen 3.146 N/A SER 339.A N ASP 336.A O no hydrogen 3.367 N/A SER 339.A OG ASP 336.A OD1 no hydrogen 2.762 N/A VAL 341.A N VAL 355.A O no hydrogen 2.903 N/A GLN 342.A N MET 333.A O no hydrogen 3.115 N/A GLN 342.A NE2 GLU 344.A OE1 no hydrogen 2.510 N/A ILE 343.A N TYR 353.A O no hydrogen 2.815 N/A GLU 344.A N ARG 331.A O no hydrogen 2.951 N/A ALA 346.A N ASN 329.A O no hydrogen 2.895 N/A ALA 347.A N ASP 345.A OD1 no hydrogen 2.715 N/A SER 348.A N ASP 345.A O no hydrogen 3.426 N/A ALA 352.A N VAL 173.A O no hydrogen 2.845 N/A TYR 353.A N ILE 343.A O no hydrogen 3.084 N/A TYR 353.A OH ALA 135.A O no hydrogen 2.640 N/A VAL 354.A N LEU 171.A O no hydrogen 2.895 N/A VAL 355.A N VAL 341.A O no hydrogen 2.912 N/A MET 356.A N HIS 169.A O no hydrogen 2.973 N/A MET 358.A N GLY 312.A O no hydrogen 2.763 N/A